Computational chemistry group of Ragnar Bjornsson at LCBM - Laboratoire de chimie et biologie des métaux, at the CEA in Grenoble.
Joined January 2011
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Ragnar Bjornsson retweeted
We are pleased to see our theoretical study of the electronic structure of dialumenes published in @PCCP
Fruitful collaboration with my friend @RagnarBj at CEA Grenoble, calculations expertly done by my PhD student @keelan542 @MaynoothChem
pubs.rsc.org/en/content/arti…
Ragnar Bjornsson retweeted
My research group @iitmadras is looking for PhD students to work in the area of theoretical and computational chemistry. CSIR-UGC,GATE,INSPIRE qualified candidates must complete their application before 31st March- research.iitm.ac.in/ . Send your CV to [email protected].
2 open PhD positions in #compchem in our group in Grenoble, France at the CEA
1. Predicting new catalysts for N2 fixation.
2. QM/MM and crystallography of CODH. With @kikicavazza. Funded by @LabexArcane
See sites.google.com/site/ragnar…
#compinorgchem #inorganic #bioinorganic
Both projects will involve using and/or developing ASH, our multiscale modelling program:
ash.readthedocs.io
github.com/RagnarB83/ash
NiFe carbon monoxide dehydrogenase (CODH) is Nature's way of interconverting CO2 and CO.
See arcane.univ-grenoble-alpes.f… for more information.
Ragnar Bjornsson retweeted
We have an opportunity to apply for PhD funding in my group through the John & Pat Hume Scholarship. If you are interested in applying for a project in Computational Chemistry, please see the link below for further details. @MaynoothUni #compchem
maynoothuniversity.ie/gradua…
Ragnar Bjornsson retweeted
📢📢📢 Call for nominations: QBIC Award for 2023 and 2024. Please email your nominee to Vera Krewald krewald at chemie.tu-darmstadt.de no later than 15.02.24 more info here: qbicsoc.org/awards.html @Marcel_Swart @D_A_Pantazis @MSDLabMD
Ragnar Bjornsson retweeted
Do not miss 6th Quantum Bioinorganic Chemistry Conference! Poster abstracts accepted until 13.08. Registration utill conference start on 29.08. Check our exciting program: qbicvi.sciencesconf.org/reso…
@RagnarBj @QBICSoc @JCIM_JCTC @ICHF_PAN @CandelaNGO #qbicvi
QBIC-VI is approaching! Check out the program: qbicvi.sciencesconf.org/reso…
Poster abstract submission deadline : August 13th.
@QBICSoc will sponsor talk and poster awards.
RSC journal (PCCP and Dalton) thematic issue in connection with QBIC-VI (TBA).
#QBIC #compchem #inorgchem
Ragnar Bjornsson retweeted
Meet the QBIC VI keynote speakers: Martin Kaupp, Robert Izsák, Elżbieta Gumienna-Kontecka, Christophe Léger…
@QBICSoc
@RagnarBj
@CandelaNGO
#compchem #qbicvi
Ragnar Bjornsson retweeted
Meet the QBIC VI plenary speakers: prof. Jochen Blumberger (UCL, UK) and prof. Pavel Jungwirth. Early bird registration is still active (deadline 1st July), poster abstracts are accepted until 13.08.2023! qbicvi.sciencesconf.org/
@QBICSoc @RagnarBj @CandelaNGO #compchem #qbicvi
Ragnar Bjornsson retweeted
Finally out - we show how to get closer to complete PNO space in DLPNO-CCSD(T) in an economic way with MP2 method! The supplementary cover will follow!
pubs.acs.org/doi/full/10.102…
#compchem @jctc_papers @JCIM_JCTC
Ragnar Bjornsson retweeted
QBIC VI schedule is online:
qbicvi.sciencesconf.org/reso…
Early bird registration has been extended to July 1st!
We also work with RSC to have a thematic issue (TBA)
#QBIC #compchem #inorgchem
@QBICSoc @RagnarBj @vera_krewald @D_A_Pantazis @Marcel_Swart @nuno_bandeira @Joanna_Kargul
Ragnar Bjornsson retweeted
We have a long weekend in Poland :) QBIC VI contributed talk abstracts are accepted by 3rd May! Poster abstracts should be submitted by 13.08.2023.
Visit conf. website for more details qbicvi.sciencesconf.org/
#qbicvi #compchem
@RagnarBj @QBICSoc
Ragnar Bjornsson retweeted
Happy to announce that QBIC VI is supported by Frédéric Billet, Ambassador of France in Warsaw @Amb_Francji, and Rafał Trzaskowski @trzaskowski_ , President of Warsaw!
Conf. website: qbicvi.sciencesconf.org/
@RagnarBj @QBICSoc @ICHF_PAN
#qbicvi #compchem
Don't forget the deadline for submitting a QBIC-VI oral talk abstract:
30th of April (end of this week)
You can also register for QBIC-VI now at:
qbicvi.sciencesconf.org
#qbicvi #compchem #theochem #inorgchem #inorganic #bioinorganic
Ragnar Bjornsson retweeted
QBIC VI registration is now open! Abstract submission deadline for contributed talks: 30.04.2023. Spread the word! I look forward to welcoming you in Warsaw! qbicvi.sciencesconf.org/
#qbicvi #compchem
@QBICSoc @RagnarBj @D_A_Pantazis @vera_krewald @MSDLabMD @Marcel_Swart
Abstract submission for QBIC-VI is now open!
The 6th Quantum Bio-Inorganic Chemistry Conference will be held from 29.08 to 01.09.2023 in Warsaw, Poland.
Contributed talk slots and poster slots are available. See qbicvi.sciencesconf.org for all information! @adkubas @QBICSoc
Ragnar Bjornsson retweeted
Very happy to share our new paper on the binding of exogenous cyanide to [FeFe] hydrogenases! Check it out 👉👉 Huge thanks to all the team involved @JamesBirrell86 @MariaAleMartini @SpanLabFAU @RagnarBj @KonstantinBikb2 @mpicec_press (1/4) pubs.rsc.org/en/content/arti…
